SCHEMBL28224848

SCHEMBL28224848

CCCC(=O)C(=Cc1ccccc1)C(=O)OCC

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.79
KMT2A Q03164 7/20 0.79
NR1H4 Q96RI1 1/20 0.59
MAPT P10636 9/20 0.59
LMNA P02545 4/20 0.59
NPSR1 Q6W5P4 3/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
S1PR4 O95977 1/20 0.59
S1PR1 P21453 1/20 0.59
MAPK1 P28482 1/20 0.59
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 2/20 0.52
HSP90AA1 P07900 2/20 0.52
HPGD P15428 1/20 0.52
PLIN1 O60240 1/20 0.51
POLB P06746 1/20 0.51
PLIN5 Q00G26 1/20 0.51
ABHD5 Q8WTS1 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Butane SCHEMBL6828046 0.89 MEN1 (0.93) MEN1KMT2ANR1H4MAPTLMNA
Benzene SCHEMBL27988126 0.89 MEN1 (1.00) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL935186 0.89 MEN1 (1.00) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL28461515 0.88 MEN1 (0.84) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL10665879 0.87 MEN1 (0.59) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL9271893 0.85 MAPT (0.78) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL9271895 0.85 MAPT (0.78) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL11187652 0.85 MEN1 (0.79) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL11187646 0.85 MEN1 (0.79) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL28213002 0.84 MEN1 (0.84) MEN1KMT2ANR1H4MAPTLMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108358831-A A kind of polysubstituted carbazole derivates and preparation method thereof 山东师范大学 2018-08-03 CN claimed
CN-108358831-B Polysubstituted carbazole derivative and preparation method thereof 山东师范大学 2020-09-29 CN disclosed
CN-108358831-A A kind of polysubstituted carbazole derivates and preparation method thereof 山东师范大学 2018-08-03 CN disclosed